Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 15/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 15/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.36 |
| ▸ | SSTR2 | P30874 | 3/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6005667 | 0.99 | ESR1 (0.40) | ESR1ESR2CHEK2SSTR2LTA4H | |
| SCHEMBL6003243 | 0.91 | ESR1 (0.41) | ESR1ESR2CHEK2SSTR2LTA4H | |
| SCHEMBL6004700 | 0.91 | ESR1 (0.40) | ESR1ESR2CHEK2SSTR2LTA4H | |
| SCHEMBL6005134 | 0.90 | ESR1 (0.42) | ESR1ESR2CHEK2SSTR2LTA4H | |
| SCHEMBL6003304 | 0.83 | CHEK2 (0.43) | ESR1ESR2CHEK2 | |
| SCHEMBL1360457 | 0.82 | ESR1 (0.58) | ESR1ESR2 | |
| SCHEMBL1360339 | 0.82 | ESR1 (0.58) | ESR1ESR2 | |
| SCHEMBL6003401 | 0.82 | CHEK2 (0.44) | ESR1ESR2CHEK2SSTR2LTA4H | |
| Hydrochloric Acid SCHEMBL1358199 | 0.82 | ESR1 (0.59) | ESR1ESR2 | |
| SCHEMBL6192185 | 0.78 | CHEK2 (0.36) | ESR1ESR2CHEK2SSTR2LTA4H |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1709021-A1 | SELECTIVE ESTROGEN RECEPTOR MODULATORS FOR THE TREATMENT OF VASOMOTOR SYMPTOMS | ELI LILLY AND COMPANY (US) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005073204-A1 | SELECTIVE ESTROGEN RECEPTOR MODULATORS FOR THE TREATMENT OF VASOMOTOR SYMPTOMS | ELI LILLY AND COMPANY (US) | 2005-08-11 | — | — | WO | disclosed |